Cutting-Edge Theoretical Studies

Dive into peer-reviewed articles on DFT simulations, reaction mechanisms, and ab initio calculations shaping modern chemical science.

Research Articles

The Goldilocks Principle: Designing Perfectly Stable Nanocatalysts

Discover how the Goldilocks Principle revolutionizes nanocatalyst design by balancing metal-support interactions for unprecedented stability and performance.

Nora Murphy
Oct 30, 2025

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